| SpectraBase Spectrum ID |
EsybokiqyMW |
| Name |
DL-Homocysteine, N-acetyl-S-phenyl-, 2,6-bis(1,1-dimethylethyl)-4-methoxyphenyl ester |
| Alternate Name(s) |
2,6-Ditert-butyl-4-methoxyphenyl 2-(acetylamino)-4-(phenylsulfanyl)butanoate
[2,6-bis(1,1-dimethylethyl)-4-methoxyphenyl]-2-acetamido-4-(phenylthio)butanoate |
| CAS Registry Number |
113719-19-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H37NO4S |
| InChI |
InChI=1S/C27H37NO4S/c1-18(29)28-23(14-15-33-20-12-10-9-11-13-20)25(30)32-24-21(26(2,3)4)16-19(31-8)17-22(24)27(5,6)7/h9-13,16-17,23H,14-15H2,1-8H3,(H,28,29) |
| InChIKey |
VAIPCCSLTKVOAF-UHFFFAOYSA-N |
| Molecular Weight |
471.656 g/mol |
| SMILES |
N(C(C(Oc1c(C(C)(C)C)cc(cc1C(C)(C)C)OC)=O)CCSc1ccccc1)C(=O)C |
| SPLASH |
splash10-059l-8690000000-5b1758b3326fc0063c21 |
| Source of Spectrum |
H-70-1514-21 |
| Wiley ID |
1393132 |
